Halide Pb-Free Double–Perovskites: Ternary vs. Quaternary Stoichiometry

Abstract

In view of their applicability in optoelectronics, we review here the relevant structural, electronic, and optical features of the inorganic Pb-free halide perovskite class. In particular, after discussing the reasons that have motivated their introduction in opposition to their more widely investigated organic-inorganic counterparts, we highlight milestones already achieved in their synthesis and characterization and show how the use of ab initio ground and excited state methods is relevant in predicting their properties and in disclosing yet unsolved issues which characterize both ternary and quaternary stoichiometry double-perovskites.

Keywords

• lead-free inorganic halide perovskites
• <i>ab-initio</i> ground and excited state analysis
• photovoltaics
• optoelectronic applications